| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 30 | No |
Popular Name: (5S)-4-(2,4-dimethoxybenzoyl)-3-hydroxy-5-(3-pyridyl)-1-thiazol-2-yl-5H-pyrrol-2-one (5S)-4-(2,4-dimethoxybenzoyl)-3-…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.93 | 7.11 | -61.57 | 0 | 8 | -1 | 105 | 422.442 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.38 | 5.98 | -27.03 | 1 | 8 | 0 | 102 | 423.45 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 7.15 | -22.99 | 0 | 8 | 0 | 99 | 423.45 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.38 | 6.27 | -55.04 | 2 | 8 | 1 | 103 | 424.458 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.35 | 7.44 | -48.61 | 1 | 8 | 1 | 100 | 424.458 | 6 | ↓ |
